1-[1-[1-(5-fluoro-2-pyridinyl)propyl]piperidin-4-yl]-N-methylmethanamine

C15H24FN3 — CID 112585626

IUPAC1-[1-[1-(5-fluoro-2-pyridinyl)propyl]piperidin-4-yl]-N-methylmethanamine
SMILESCCC(c1ccc(F)cn1)N1CCC(CNC)CC1
InChIInChI=1S/C15H24FN3/c1-3-15(14-5-4-13(16)11-18-14)19-8-6-12(7-9-19)10-17-2/h4-5,11-12,15,17H,3,6-10H2,1-2H3
InChIKeyVNKMYHBSLFQDFG-UHFFFAOYSA-N
MW265.38 g/mol
LogP2.60
Rot. Bonds5

About 1-[1-[1-(5-fluoro-2-pyridinyl)propyl]piperidin-4-yl]-N-methylmethanamine

1-[1-[1-(5-fluoro-2-pyridinyl)propyl]piperidin-4-yl]-N-methylmethanamine (PubChem CID 112585626) has the molecular formula C15H24FN3 and a molecular weight of 265.38 g/mol. Its IUPAC name is 1-[1-[1-(5-fluoro-2-pyridinyl)propyl]piperidin-4-yl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[1-[1-(5-fluoro-2-pyridinyl)propyl]piperidin-4-yl]-N-methylmethanamine
PubChem CID112585626
Molecular FormulaC15H24FN3
Molecular Weight265.38 g/mol
Exact Mass265.20
IUPAC Name1-[1-[1-(5-fluoro-2-pyridinyl)propyl]piperidin-4-yl]-N-methylmethanamine
SMILESCCC(c1ccc(F)cn1)N1CCC(CNC)CC1
InChIInChI=1S/C15H24FN3/c1-3-15(14-5-4-13(16)11-18-14)19-8-6-12(7-9-19)10-17-2/h4-5,11-12,15,17H,3,6-10H2,1-2H3
InChIKeyVNKMYHBSLFQDFG-UHFFFAOYSA-N
XLogP2.60
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.38
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[1-[1-(5-fluoro-2-pyridinyl)ethyl]piperidin-4-yl]-N-methylmethanamine
CID 83124667
1-[1-[1-(4-fluorophenyl)propyl]piperidin-4-yl]-N-methylmethanamine;hydrochloride
CID 119922604
1-[1-(5-fluoro-2-pyridinyl)propyl]piperidin-3-amine
CID 112585618
1-[1-(5-fluoro-2-pyridinyl)propyl]pyrrolidine-3-carboxylic acid
CID 112586688
4-ethyl-1-[1-(5-fluoro-2-pyridinyl)propyl]piperidine-4-carboxylic acid
CID 115941705
2-[1-[1-(5-fluoro-2-pyridinyl)ethyl]piperidin-4-yl]ethanamine
CID 83124823
1-[1-(5-fluoro-2-pyridinyl)propyl]-3-propylpyrrolidine-3-carboxylic acid
CID 115941701
N-[1-(5-fluoro-2-pyridinyl)propyl]-1,3-dimethylpiperidin-4-amine
CID 114503283
1-(5-fluoro-2-pyridinyl)-3-[4-(methoxymethyl)piperidin-1-yl]-N-methylpropan-1-amine
CID 83111511
3-amino-1-[1-(5-fluoro-2-pyridinyl)propyl]pyrrolidine-3-carboxylic acid
CID 107321041
1-[1-(5-fluoro-2-pyridinyl)piperidin-3-yl]-N-methylmethanamine
CID 61313343
1-[1-(5-fluoro-2-pyridinyl)propyl]-3-propan-2-ylpyrrolidine-3-carboxylic acid
CID 106984629

Frequently Asked Questions

What is the IUPAC name of 1-[1-[1-(5-fluoro-2-pyridinyl)propyl]piperidin-4-yl]-N-methylmethanamine?
The IUPAC name of 1-[1-[1-(5-fluoro-2-pyridinyl)propyl]piperidin-4-yl]-N-methylmethanamine (CID 112585626) is 1-[1-[1-(5-fluoro-2-pyridinyl)propyl]piperidin-4-yl]-N-methylmethanamine.
What is the SMILES notation for 1-[1-[1-(5-fluoro-2-pyridinyl)propyl]piperidin-4-yl]-N-methylmethanamine?
The canonical SMILES for 1-[1-[1-(5-fluoro-2-pyridinyl)propyl]piperidin-4-yl]-N-methylmethanamine is CCC(c1ccc(F)cn1)N1CCC(CNC)CC1.
What is the InChIKey of 1-[1-[1-(5-fluoro-2-pyridinyl)propyl]piperidin-4-yl]-N-methylmethanamine?
The InChIKey is VNKMYHBSLFQDFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24FN3/c1-3-15(14-5-4-13(16)11-18-14)19-8-6-12(7-9-19)10-17-2/h4-5,11-12,15,17H,3,6-10H2,1-2H3.
What are the key properties of 1-[1-[1-(5-fluoro-2-pyridinyl)propyl]piperidin-4-yl]-N-methylmethanamine?
1-[1-[1-(5-fluoro-2-pyridinyl)propyl]piperidin-4-yl]-N-methylmethanamine has a molecular weight of 265.38 g/mol, XLogP of 2.60, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[1-(5-fluoro-2-pyridinyl)propyl]piperidin-4-yl]-N-methylmethanamine is sourced from PubChem (CID 112585626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).